Compound Identification
SMILES
CC1=C(C)S(=O)(=O)C(C)=C(C#N)C(C#N)=C1C
InChIKey
InChIKey=WTWGIRQIVPEEHD-UHFFFAOYSA-N
Formula
C12H12N2O2S
Mass
248.3
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
- Class Thiepins
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Thiepins
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Thiepins
Alternative Parents
Molecular Framework
Aliphatic heteromonocyclic compounds
Substituents
Thiepin - Sulfone - Nitrile - Carbonitrile - Organic nitrogen compound - Organic oxygen compound - Cyanide - Organic oxide - Hydrocarbon derivative - Organonitrogen compound - Aliphatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as thiepins. These are heterocyclic compounds containing an unsaturated seven-member heterocycle, with six carbon atoms and one sulfur atom.
External Descriptors
Not available